(2S,3R)-3-azanyl-2,3-dihydro-1H-cyclopenta[b]naphthalen-2-ol; 2-(4-chlorophenyl)propanoic acid

Systemtic Name: (2S,3R)-3-azanyl-2,3-dihydro-1H-cyclopenta[b]naphthalen-2-ol; 2-(4-chlorophenyl)propanoic acid Openeye Name: (2S,3R)-3-amino-2,3-dihydro-1H-cyclopenta[b]naphthalen-2-ol; 2-(4-chlorophenyl)propanoic acid CAS Name: (2S,3R)-3-amino-2,3-dihydro-1H-cyclopenta[b]naphthalen-2-ol; 2-(4-chlorophenyl)propanoic acid IUPAC Name: (2S,3R)-3-amino-2,3-dihydro-1H-cyclopenta[b]naphthalen-2-ol; 2-(4-chlorophenyl)propanoic acid Traditional Name: (1R,2S)-1-amino-2,3-dihydro-1H-benz[f]inden-2-ol; 2-(4-chlorophenyl)propionic acid Formula: C22H22ClNO3 MolecularWeight: 383.86798

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)Cl)C(=O)O.C1C(C(C2=CC3=CC=CC=C3C=C21)N)O

Isomeric SMILES

CC(C1=CC=C(C=C1)Cl)C(=O)O.C1[C@@H]([C@@H](C2=CC3=CC=CC=C3C=C21)N)O

InChI

InChI=1S/C13H13NO.C9H9ClO2/c14-13-11-6-9-4-2-1-3-8(9)5-10(11)7-12(13)15;1-6(9(11)12)7-2-4-8(10)5-3-7/h1-6,12-13,15H,7,14H2;2-6H,1H3,(H,11,12)/t12-,13+;/m0./s1